CID 4020

Mazindol

Structural Information

Molecular Formula
C16H13ClN2O
SMILES
C1CN2C(=N1)C3=CC=CC=C3C2(C4=CC=C(C=C4)Cl)O
InChI
InChI=1S/C16H13ClN2O/c17-12-7-5-11(6-8-12)16(20)14-4-2-1-3-13(14)15-18-9-10-19(15)16/h1-8,20H,9-10H2
InChIKey
ZPXSCAKFGYXMGA-UHFFFAOYSA-N
Compound name
5-(4-chlorophenyl)-2,3-dihydroimidazo[1,2-b]isoindol-5-ol
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

715
References

25238
Patents

284.07166 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.07894 164.7
[M+Na]+ 307.06088 176.2
[M-H]- 283.06438 170.1
[M+NH4]+ 302.10548 185.7
[M+K]+ 323.03482 168.9
[M+H-H2O]+ 267.06892 157.2
[M+HCOO]- 329.06986 179.6
[M+CH3COO]- 343.08551 176.9
[M+Na-2H]- 305.04633 168.3
[M]+ 284.07111 166.4
[M]- 284.07221 166.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.